Geometry & MOs

Info

ID:	33696
PubChem CID:	7887534
Reduced:	FNO5C18H18 (1)
Stoich.:	ABC5D18E18 (1)
Weight, g/mol:	396.98771
ΔH_f, kcal/mol:	-211.77
Dipole, Da:	5.89
IP(EA), eV:	-8.38(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,4-dichlorophenyl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1NC(=O)COC(=O)C2=C(C=C(C=C2)OC)F

DOS

IR

Vibrations